SCHEMBL27628628

SCHEMBL27628628

CC(=O)OCC=Cc1cccc(O)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 2/20 0.49
CCNB2 O95067 1/20 0.49
CDK1 P06493 1/20 0.49
CDK4 P11802 1/20 0.49
CCNB1 P14635 1/20 0.49
CCND1 P24385 1/20 0.49
CCNB3 Q8WWL7 1/20 0.49
CA12 O43570 2/20 0.46
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
CA4 P22748 2/20 0.46
CA6 P23280 2/20 0.46
CA5A P35218 2/20 0.46
CA7 P43166 2/20 0.46
CA9 Q16790 2/20 0.46
CA13 Q8N1Q1 2/20 0.46
CA14 Q9ULX7 2/20 0.46
CA5B Q9Y2D0 2/20 0.46
AKR1B10 O60218 2/20 0.46
AKR1B1 P15121 2/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9997372 0.86 CACNA1B (0.49) FBP1MMP1MMP2MMP9MAOA
SCHEMBL6752491 0.86 CACNA1B (0.49) FBP1MMP1MMP2MMP9MAOA
SCHEMBL9997657 0.84 CYP1A2 (0.53) MMP1MMP2MMP9MAOAMAOB
SCHEMBL9997659 0.84 CYP1A2 (0.53) MMP1MMP2MMP9MAOAMAOB
SCHEMBL9997281 0.84 SLC6A19 (0.54) MMP1MMP2MMP9MAOAMAOB
SCHEMBL8804394 0.84 SLC6A19 (0.54) MMP1MMP2MMP9MAOAMAOB
SCHEMBL9998506 0.84 NFE2L2 (0.50) MAOAMAOB
SCHEMBL9998507 0.84 NFE2L2 (0.50) MAOAMAOB
SCHEMBL3585478 0.83 CHRM2 (0.55) CA12CA1CA2CA9FBP1
SCHEMBL9998603 0.83 CYP4F2 (0.46) AKR1B10AKR1B1MMP1MMP2MMP9

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1805951-A Substituted piperidine carbamates for use as inhibitors of hormone sensitive lipase NOVO NORDISK AS (DK) 2006-07-19 CN disclosed